(2-oxidanylidene-1,2-diphenyl-ethyl) 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate

Systemtic Name: (2-oxidanylidene-1,2-diphenyl-ethyl) 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate Openeye Name: (2-oxo-1,2-diphenyl-ethyl) 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate CAS Name: 6-(3,5-dimethyl-1-pyrazolyl)-3-pyridinecarboxylic acid (2-oxo-1,2-diphenylethyl) ester IUPAC Name: (2-oxo-1,2-diphenylethyl) 6-(3,5-dimethylpyrazol-1-yl)pyridine-3-carboxylate Traditional Name: 6-(3,5-dimethylpyrazol-1-yl)nicotinic acid desyl ester Formula: C25H21N3O3 MolecularWeight: 411.45254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NC=C(C=C2)C(=O)OC(C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C25H21N3O3/c1-17-15-18(2)28(27-17)22-14-13-21(16-26-22)25(30)31-24(20-11-7-4-8-12-20)23(29)19-9-5-3-6-10-19/h3-16,24H,1-2H3